Geometry & MOs

Info

ID:	35525
PubChem CID:	7979987
Reduced:	O4H16C17 (1)
Stoich.:	A4B16C17 (1)
Weight, g/mol:	405.172228
ΔH_f, kcal/mol:	-115.22
Dipole, Da:	3.07
IP(EA), eV:	-9.01(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[2-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]acetyl]-4-pyrrolidin-1-ylsulfonylbenzohydrazide

Drug info:

PubChemData

Smile

C[C@@H](C1=CC=CC=C1)OC(=O)C2=CC3=C(C=C2)OCCO3

DOS

IR

Vibrations